Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | JUN | P05412 | 2/20 | 0.47 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL453737 | 0.85 | SMN1; SMN2 (0.58) | HTR6SMN1; SMN2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL4582001 | 0.76 | SMN1; SMN2 (0.56) | HTR6SMN1; SMN2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL451131 | 0.76 | NPC1 (0.52) | ALDH1A1TSHRKDM4EHPGDCXCR3 | |
| SCHEMBL12463889 | 0.75 | PTGS2 (0.47) | HTR6KMT2AMEN1PTGS2CXCR3 | |
| SCHEMBL1553514 | 0.75 | HRH3 (0.55) | SMN1; SMN2ALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL1664204 | 0.74 | TRPV1 (0.47) | HTR6SMN1; SMN2KMT2AMEN1JUN | |
| SCHEMBL450858 | 0.74 | SMN1; SMN2 (0.57) | SMN1; SMN2ALDH1A1KMT2ANPSR1MEN1 | |
| SCHEMBL13291361 | 0.74 | CXCR3 (0.57) | SMN1; SMN2ALDH1A1NPSR1MAPK1CXCR3 | |
| SCHEMBL7144891 | 0.73 | CXCR3 (0.62) | PDE10ACXCR3 | |
| SCHEMBL450061 | 0.73 | CXCR3 (0.54) | SMN1; SMN2ALDH1A1KMT2AMEN1HSD17B10 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012083190-A1 | INSECT ODORANT RECEPTOR ANTAGONISTS | THE ROCKEFELLER UNIVERSITY (US) | 2012-06-21 | — | — | WO | disclosed |